(2-oxidanylideneazepan-3-yl) 4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzoate Openeye Name: (2-oxoazepan-3-yl) 4-methoxy-3-(p-tolylsulfamoyl)benzoate CAS Name: 4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzoic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzoate Traditional Name: 4-methoxy-3-(p-tolylsulfamoyl)benzoic acid (2-ketoazepan-3-yl) ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3CCCCNC3=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3CCCCNC3=O)OC

InChI

InChI=1S/C21H24N2O6S/c1-14-6-9-16(10-7-14)23-30(26,27)19-13-15(8-11-17(19)28-2)21(25)29-18-5-3-4-12-22-20(18)24/h6-11,13,18,23H,3-5,12H2,1-2H3,(H,22,24)